2-[[3-oxidanylidene-3-[(5-propyl-1,3,4-thiadiazol-2-yl)amino]propanoyl]amino]benzoic acid

Systemtic Name: 2-[[3-oxidanylidene-3-[(5-propyl-1,3,4-thiadiazol-2-yl)amino]propanoyl]amino]benzoic acid Openeye Name: 2-[[3-oxo-3-[(5-propyl-1,3,4-thiadiazol-2-yl)amino]propanoyl]amino]benzoic acid CAS Name: 2-[[1,3-dioxo-3-[(5-propyl-1,3,4-thiadiazol-2-yl)amino]propyl]amino]benzoic acid IUPAC Name: 2-[[3-oxo-3-[(5-propyl-1,3,4-thiadiazol-2-yl)amino]propanoyl]amino]benzoic acid Traditional Name: 2-[[3-keto-3-[(5-propyl-1,3,4-thiadiazol-2-yl)amino]propanoyl]amino]benzoic acid Formula: C15H16N4O4S MolecularWeight: 348.37694

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN=C(S1)NC(=O)CC(=O)NC2=CC=CC=C2C(=O)O

Isomeric SMILES

CCCC1=NN=C(S1)NC(=O)CC(=O)NC2=CC=CC=C2C(=O)O

InChI

InChI=1S/C15H16N4O4S/c1-2-5-13-18-19-15(24-13)17-12(21)8-11(20)16-10-7-4-3-6-9(10)14(22)23/h3-4,6-7H,2,5,8H2,1H3,(H,16,20)(H,22,23)(H,17,19,21)